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14227-17-9 | Benzenamine, 2,4,6-trimethoxy-
CAS No: 14227-17-9 Catalog No: AG001I3E MDL No:MFCD00017165
Product Description
Catalog Number:
AG001I3E
Chemical Name:
Benzenamine, 2,4,6-trimethoxy-
CAS Number:
14227-17-9
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
MDL Number:
MFCD00017165
IUPAC Name:
2,4,6-trimethoxyaniline
InChI:
InChI=1S/C9H13NO3/c1-11-6-4-7(12-2)9(10)8(5-6)13-3/h4-5H,10H2,1-3H3
InChI Key:
FNSAKXLEFPFZOM-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c(c(c1)OC)N
EC Number:
238-095-8
Properties
Complexity:
140
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
53.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Minor secondary metabolic products from the stem bark of Plumeria rubra Linn. displaying antimicrobial activities. | Planta medica 20100401 |
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